N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)isonipecotamide Formula: C19H20BrN5O MolecularWeight: 414.299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C(=NC=N2)N3CCC(CC3)C(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CNC2=C1C(=NC=N2)N3CCC(CC3)C(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C19H20BrN5O/c1-12-10-21-17-16(12)18(23-11-22-17)25-7-5-13(6-8-25)19(26)24-15-4-2-3-14(20)9-15/h2-4,9-11,13H,5-8H2,1H3,(H,24,26)(H,21,22,23)